![#2;TRIGONEOSIDE-IIB;26-O-BETA-D-GLUCOPYRANOSYL-3-BETA,22-XI,26-TRIHYDROXY-(25R)-5-BETA-FUROSTANE-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/HWoZpHtC8Ah/structure.png?h=300&w=458 "#2;TRIGONEOSIDE-IIB;26-O-BETA-D-GLUCOPYRANOSYL-3-BETA,22-XI,26-TRIHYDROXY-(25R)-5-BETA-FUROSTANE-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | C5dBDBpGZgx |
|---|---|
| InChI | InChI=1S/C44H74O18/c1-19(16-56-40-37(53)34(50)32(48)28(15-45)60-40)7-12-44(55)20(2)30-27(62-44)14-25-23-6-5-21-13-22(8-10-42(21,3)24(23)9-11-43(25,30)4)59-41-38(54)35(51)33(49)29(61-41)18-58-39-36(52)31(47)26(46)17-57-39/h19-41,45-55H,5-18H2,1-4H3/t19-,20+,21-,22+,23-,24+,25+,26-,27+,28+,29-,30+,31+,32+,33-,34-,35+,36-,37+,38-,39+,40+,41-,42?,43?,44?/m1/s1 |
| InChIKey | ISFAETRPBLFKQD-SPMZVDTHSA-N |
| Mol Weight | 891.1 g/mol |
| Molecular Formula | C44H74O18 |
| Exact Mass | 890.487516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HWoZpHtC8Ah |
|---|---|
| Name | #2;TRIGONEOSIDE-IIB;26-O-BETA-D-GLUCOPYRANOSYL-3-BETA,22-XI,26-TRIHYDROXY-(25R)-5-BETA-FUROSTANE-3-O-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H74O18 |
| InChI | InChI=1S/C44H74O18/c1-19(16-56-40-37(53)34(50)32(48)28(15-45)60-40)7-12-44(55)20(2)30-27(62-44)14-25-23-6-5-21-13-22(8-10-42(21,3)24(23)9-11-43(25,30)4)59-41-38(54)35(51)33(49)29(61-41)18-58-39-36(52)31(47)26(46)17-57-39/h19-41,45-55H,5-18H2,1-4H3/t19-,20+,21-,22+,23-,24+,25+,26-,27+,28+,29-,30+,31+,32+,33-,34-,35+,36-,37+,38-,39+,40+,41-,42?,43?,44?/m1/s1 |
| InChIKey | ISFAETRPBLFKQD-SPMZVDTHSA-N |
| Literature Reference Author | P.K.AGRAWAL |
| Literature Reference Citation | STEROIDS,70,715(2005) |
| Literature Reference DOI | 10.1016/j.steroids.2005.04.001 |
| Molecular Weight | 891.061 g/mol |
| Sample ID | 968747 |
| Solvent | C5D5N |